1-methyl-5-[3-(3-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid

Systemtic Name: 1-methyl-5-[3-(3-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Openeye Name: 1-methyl-5-[3-(3-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid CAS Name: 1-methyl-5-[[3-(3-methyl-1-pyrazolyl)propylamino]-oxomethyl]-4-pyrazolecarboxylic acid IUPAC Name: 1-methyl-5-[3-(3-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Traditional Name: 1-methyl-5-[3-(3-methylpyrazol-1-yl)propylcarbamoyl]pyrazole-4-carboxylic acid Formula: C13H17N5O3 MolecularWeight: 291.30578

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Descriptors Computed from Structure

Canonical SMILES:

CC1=NN(C=C1)CCCNC(=O)C2=C(C=NN2C)C(=O)O

Isomeric SMILES

CC1=NN(C=C1)CCCNC(=O)C2=C(C=NN2C)C(=O)O

InChI

InChI=1S/C13H17N5O3/c1-9-4-7-18(16-9)6-3-5-14-12(19)11-10(13(20)21)8-15-17(11)2/h4,7-8H,3,5-6H2,1-2H3,(H,14,19)(H,20,21)